SCHEMBL7969237

SCHEMBL7969237

Cc1nc(-c2[c]nc(Cl)cc2)cs1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
GAA P10253 4/20 0.38
RECQL P46063 3/20 0.38
KDM4E B2RXH2 2/20 0.38
POLB P06746 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 2/20 0.38
ESR2 Q92731 1/20 0.38
TSHR P16473 1/20 0.37
HTT P42858 2/20 0.36
ECE1 P42892 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
HSD17B10 Q99714 1/20 0.35
KDM4A O75164 1/20 0.34
KDM4B O94953 1/20 0.34
KDM5C P41229 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
ROCK2 O75116 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3137125 0.71 RECQL (0.41) RAB9ANPC1GAARECQLKDM4E
SCHEMBL24359598 0.69 GAA (0.52) RAB9ANPC1GAARECQLKDM4E
SCHEMBL11982624 0.68 RAB9A (0.51) RAB9ANPC1GAARECQLKDM4E
SCHEMBL5027454 0.67 GAA (0.41) RAB9ANPC1GAARECQLKDM4E
SCHEMBL2405184 0.66 RAB9A (0.71) RAB9ANPC1GAARECQLKDM4E
SCHEMBL21143970 0.66 RAB9A (0.45) RAB9ANPC1GAARECQLKDM4E
SCHEMBL28567385 0.66 RAB9A (0.41) RAB9ANPC1GAARECQLKDM4E
SCHEMBL3845266 0.66 RECQL (0.42) RAB9ANPC1GAARECQLKDM4E
SCHEMBL2642889 0.65
SCHEMBL19626559 0.65 RECQL (0.49) RAB9ANPC1GAARECQLKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001017965-A2 CYANOPIPERIDINES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2001-03-15 WO disclosed